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canSAR111369
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NAMES
    SMILES
    O=C(Nc1ccccc1Cl)Nc1ncnc2c1sc(=S)n2-c1ccccc1
    InChI
    InChI=1S/C18H12ClN5OS2/c19-12-8-4-5-9-13(12)22-17(25)23-15-14-16(21-10-20-15)24(18(26)27-14)11-6-2-1-3-7-11/h1-10H,(H2,20,21,22,23,25)
    MOLECULAR FORMULA
    C18H12ClN5OS2
    CROSS REFERENCES
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    canSAR111369

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 413.02
    AlogP 5.51
    HBond donors 2
    HBond acceptors 6
    Atoms 39
    Contains toxicophore No
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR111369.